N-[(3R)-1-(3-methoxyphenyl)piperidin-3-yl]-2-(3-methyl-4-pyridinyl)acetamide

C20H25N3O2 — CID 124618191

IUPACN-[(3R)-1-(3-methoxyphenyl)piperidin-3-yl]-2-(3-methyl-4-pyridinyl)acetamide
SMILESCOc1cccc(N2CCC[C@@H](NC(=O)Cc3ccncc3C)C2)c1
InChIInChI=1S/C20H25N3O2/c1-15-13-21-9-8-16(15)11-20(24)22-17-5-4-10-23(14-17)18-6-3-7-19(12-18)25-2/h3,6-9,12-13,17H,4-5,10-11,14H2,1-2H3,(H,22,24)/t17-/m1/s1
InChIKeyRDIXIYZXPKBWEZ-QGZVFWFLSA-N
MW339.44 g/mol
LogP2.73
Rot. Bonds5

About N-[(3R)-1-(3-methoxyphenyl)piperidin-3-yl]-2-(3-methyl-4-pyridinyl)acetamide

N-[(3R)-1-(3-methoxyphenyl)piperidin-3-yl]-2-(3-methyl-4-pyridinyl)acetamide (PubChem CID 124618191) has the molecular formula C20H25N3O2 and a molecular weight of 339.44 g/mol. Its IUPAC name is N-[(3R)-1-(3-methoxyphenyl)piperidin-3-yl]-2-(3-methyl-4-pyridinyl)acetamide.

Molecular Properties

Compound NameN-[(3R)-1-(3-methoxyphenyl)piperidin-3-yl]-2-(3-methyl-4-pyridinyl)acetamide
PubChem CID124618191
Molecular FormulaC20H25N3O2
Molecular Weight339.44 g/mol
Exact Mass339.19
IUPAC NameN-[(3R)-1-(3-methoxyphenyl)piperidin-3-yl]-2-(3-methyl-4-pyridinyl)acetamide
SMILESCOc1cccc(N2CCC[C@@H](NC(=O)Cc3ccncc3C)C2)c1
InChIInChI=1S/C20H25N3O2/c1-15-13-21-9-8-16(15)11-20(24)22-17-5-4-10-23(14-17)18-6-3-7-19(12-18)25-2/h3,6-9,12-13,17H,4-5,10-11,14H2,1-2H3,(H,22,24)/t17-/m1/s1
InChIKeyRDIXIYZXPKBWEZ-QGZVFWFLSA-N
XLogP2.73
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[1-(3-methoxyphenyl)piperidin-3-yl]-2-methyl-3-[2-(3-methyl-4-pyridinyl)ethyl]guanidine;hydroiodide
CID 109405844
2-amino-N-[1-(3-methoxyphenyl)piperidin-3-yl]acetamide
CID 119884236
1-ethyl-3-[1-(3-methoxyphenyl)piperidin-3-yl]-2-[2-(3-methyl-4-pyridinyl)ethyl]guanidine;hydroiodide
CID 109405842
3-amino-N-[1-(3-methoxyphenyl)piperidin-3-yl]butanamide
CID 119884246
N-[(3R)-1-(3-methoxyphenyl)piperidin-3-yl]cyclopropanecarboxamide
CID 53318242
(E)-N-[(3R)-1-(3-methoxyphenyl)piperidin-3-yl]-3-pyridin-3-ylprop-2-enamide
CID 98512279
(Z)-N-[(3R)-1-(3-methoxyphenyl)piperidin-3-yl]-3-pyridin-3-ylprop-2-enamide
CID 100831445
2-cyclopropyl-2-methoxy-N-[1-(3-methoxyphenyl)piperidin-3-yl]acetamide
CID 136538572
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[1-(3-methoxyphenyl)piperidin-3-yl]acetamide;dihydrochloride
CID 119884229
(2S,3R)-2-ethyl-3-hydroxy-N-[(3R)-1-(3-methoxyphenyl)piperidin-3-yl]butanamide
CID 124861385
N-[1-(3-methoxyphenyl)piperidin-3-yl]-3-piperidin-4-ylbutanamide;dihydrochloride
CID 119884239
1-[(1-acetylpiperidin-4-yl)methyl]-3-[1-(3-methoxyphenyl)piperidin-3-yl]urea
CID 136526374

Frequently Asked Questions

What is the IUPAC name of N-[(3R)-1-(3-methoxyphenyl)piperidin-3-yl]-2-(3-methyl-4-pyridinyl)acetamide?
The IUPAC name of N-[(3R)-1-(3-methoxyphenyl)piperidin-3-yl]-2-(3-methyl-4-pyridinyl)acetamide (CID 124618191) is N-[(3R)-1-(3-methoxyphenyl)piperidin-3-yl]-2-(3-methyl-4-pyridinyl)acetamide.
What is the SMILES notation for N-[(3R)-1-(3-methoxyphenyl)piperidin-3-yl]-2-(3-methyl-4-pyridinyl)acetamide?
The canonical SMILES for N-[(3R)-1-(3-methoxyphenyl)piperidin-3-yl]-2-(3-methyl-4-pyridinyl)acetamide is COc1cccc(N2CCC[C@@H](NC(=O)Cc3ccncc3C)C2)c1.
What is the InChIKey of N-[(3R)-1-(3-methoxyphenyl)piperidin-3-yl]-2-(3-methyl-4-pyridinyl)acetamide?
The InChIKey is RDIXIYZXPKBWEZ-QGZVFWFLSA-N. The full InChI is InChI=1S/C20H25N3O2/c1-15-13-21-9-8-16(15)11-20(24)22-17-5-4-10-23(14-17)18-6-3-7-19(12-18)25-2/h3,6-9,12-13,17H,4-5,10-11,14H2,1-2H3,(H,22,24)/t17-/m1/s1.
What are the key properties of N-[(3R)-1-(3-methoxyphenyl)piperidin-3-yl]-2-(3-methyl-4-pyridinyl)acetamide?
N-[(3R)-1-(3-methoxyphenyl)piperidin-3-yl]-2-(3-methyl-4-pyridinyl)acetamide has a molecular weight of 339.44 g/mol, XLogP of 2.73, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R)-1-(3-methoxyphenyl)piperidin-3-yl]-2-(3-methyl-4-pyridinyl)acetamide is sourced from PubChem (CID 124618191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).